2-[(furan-2-ylcarbonylamino)-(5-methyl-4-oxidanylidene-3,1-benzoxazin-2-yl)amino]-3-phenyl-propanoic acid

Systemtic Name: 2-[(furan-2-ylcarbonylamino)-(5-methyl-4-oxidanylidene-3,1-benzoxazin-2-yl)amino]-3-phenyl-propanoic acid Openeye Name: 2-[(furan-2-carbonylamino)-(5-methyl-4-oxo-3,1-benzoxazin-2-yl)amino]-3-phenyl-propanoic acid CAS Name: 2-[[[2-furanyl(oxo)methyl]amino]-(5-methyl-4-oxo-3,1-benzoxazin-2-yl)amino]-3-phenylpropanoic acid IUPAC Name: 2-[(furan-2-carbonylamino)-(5-methyl-4-oxo-3,1-benzoxazin-2-yl)amino]-3-phenylpropanoic acid Traditional Name: 2-[(2-furoylamino)-(4-keto-5-methyl-3,1-benzoxazin-2-yl)amino]-3-phenyl-propionic acid Formula: C23H19N3O6 MolecularWeight: 433.41346

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C(=CC=C1)N=C(OC2=O)N(C(CC3=CC=CC=C3)C(=O)O)NC(=O)C4=CC=CO4

Isomeric SMILES

CC1=C2C(=CC=C1)N=C(OC2=O)N(C(CC3=CC=CC=C3)C(=O)O)NC(=O)C4=CC=CO4

InChI

InChI=1S/C23H19N3O6/c1-14-7-5-10-16-19(14)22(30)32-23(24-16)26(25-20(27)18-11-6-12-31-18)17(21(28)29)13-15-8-3-2-4-9-15/h2-12,17H,13H2,1H3,(H,25,27)(H,28,29)